Geometry & MOs

Info

ID:	293591
PubChem CID:	117393955
Reduced:	FO4C13H17 (1)
Stoich.:	AB4C13D17 (1)
Weight, g/mol:	256.111087
ΔH_f, kcal/mol:	-204.25
Dipole, Da:	7.0
IP(EA), eV:	-9.06(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-(fluoromethyl)-2,4-dimethoxyphenyl]-2-methylpropanoic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1OC)OC)F)CC(C)C(=O)O

DOS

IR

Vibrations